SCHEMBL5773681

SCHEMBL5773681

Cc1nc(N2CCCCC2)c2nc(-c3ccccc3)cc-2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 16/20 0.54
HSD17B10 Q99714 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HPGD P15428 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5771896 0.99 NPY5R (0.52) NPY5RHSD17B10KMT2AKDM4EL3MBTL1
Hydrochloric Acid SCHEMBL5777287 0.96 NPY5R (0.50) NPY5RHSD17B10KMT2AKDM4EL3MBTL1
SCHEMBL5773349 0.96 NPY5R (0.52) NPY5RHSD17B10KMT2AKDM4EL3MBTL1
Hydrochloric Acid SCHEMBL5776807 0.94 NPY5R (0.50) NPY5RHSD17B10KMT2AKDM4EL3MBTL1
SCHEMBL5772625 0.89 MELK (0.45) NPY5RHSD17B10KDM4EHPGD
SCHEMBL5774815 0.89 NPY5R (0.54) NPY5RHSD17B10KMT2AKDM4EHPGD
SCHEMBL5773980 0.88 NPY5R (0.55) NPY5RHSD17B10KMT2AKDM4EL3MBTL1
SCHEMBL5775329 0.86 KDM4E (0.45) NPY5RHSD17B10KDM4EHPGD
Hydrochloric Acid SCHEMBL5773699 0.86 MELK (0.44) NPY5RHSD17B10KDM4EHPGD
SCHEMBL8126501 0.85 NPY5R (0.46) NPY5RHSD17B10KDM4EHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054887-B1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC (US) 2006-04-12 EP disclosed
US-6583154-B1 Neuropeptide Y antagonist; pyrrolo-(3,2-b)pyridines and pyrrolo-(3,2-d)pyrimidines AMGEN INC. 2003-06-24 US disclosed
US-6187777-B1 PYRROLO(3,2-D)PYRIMIDINE DERIVATIVES; NEUROPEPTIDE Y AND CORTICOTROPIN RELEASING FACTOR MODULATORS; DIETETICS; ANTIDIABETIC, ANTIINFLAMMATORY, AND ANTITUMOR AGENTS AMGEN INC. 2001-02-13 US disclosed